Data quality metrics extracted from 4qfk.cif.gz by aB_cif2table1 from BUSTER (Global Phasing Ltd.). See also the PDBx/mmCIF dictionary.

Raw JSON data
{
  "mxlims_type": "ReflectionSet",
  "version": "0.2.2",
  "uuid": "881988d15d25a92f81f997f6fbb555fa",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 93.386,
    "b": 93.970,
    "c": 140.549,
    "alpha": 80.03,
    "beta": 84.43,
    "gamma": 69.84
  },
  "wavelengths": [0.97930],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50,2.288],
    "number_observations_unique": 185390,
    "quality_factors": [
      {
        "type": "Completeness",
        "value": 95.1
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.38,2.30],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 93.6
        }
      ]
    }
  ]

}
  

Table 1 generated from MXLIMS-JSON (via JavaScript):


Binned data generated from MXLIMS-JSON (via JavaScript):